ChemSpider 2D Image | (2R)-2-Ethyl-2,5-dimethylhexanoic acid | C10H20O2

(2R)-2-Ethyl-2,5-dimethylhexanoic acid

  • Molecular FormulaC10H20O2
  • Average mass172.265 Da
  • Monoisotopic mass172.146332 Da
  • ChemSpider ID34993724

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2R)-2-Ethyl-2,5-dimethylhexanoic acid [ACD/IUPAC Name]
(2R)-2-Ethyl-2,5-dimethylhexansäure [German] [ACD/IUPAC Name]
Acide (2R)-2-éthyl-2,5-diméthylhexanoïque [French] [ACD/IUPAC Name]
Hexanoic acid, 2-ethyl-2,5-dimethyl-, (2R)- [ACD/Index Name]
2,5-Dimethyl-2-ethylhexanoic acid
24353-79-5 [RN]
UNII-RVD8OZJ00D

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.9±0.1 g/cm3
Boiling Point: 262.1±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 55.0±6.0 kJ/mol
Flash Point: 118.6±9.8 °C
Index of Refraction: 1.441
Molar Refractivity: 49.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 2.68
ACD/BCF (pH 5.5): 43.28
ACD/KOC (pH 5.5): 320.65
ACD/LogD (pH 7.4): 0.90
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.25
Polar Surface Area: 37 Å2
Polarizability: 19.8±0.5 10-24cm3
Surface Tension: 30.8±3.0 dyne/cm
Molar Volume: 188.7±3.0 cm3

Click to predict properties on the Chemicalize site


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